Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Diatrizoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Diatrizoic Acid SCHEMBL107036 | 1.00 | SMN1; SMN2 (1.00) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Diatrizoic Acid SCHEMBL1685085 | 1.00 | SMN1; SMN2 (1.00) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Diatrizoic Acid SCHEMBL2501947 | 0.99 | SMN1; SMN2 (0.97) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Diatrizoic Acid SCHEMBL468613 | 0.99 | SMN1; SMN2 (0.97) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Diatrizoic Acid SCHEMBL4334352 | 0.93 | SMN1; SMN2 (0.87) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Iothalamic Acid SCHEMBL29488709 | 0.92 | SMN1; SMN2 (0.84) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Iothalamic Acid SCHEMBL48785 | 0.92 | SMN1; SMN2 (0.84) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Iothalamic Acid SCHEMBL180546 | 0.92 | SMN1; SMN2 (0.84) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Iothalamic Acid SCHEMBL3060866 | 0.91 | SMN1; SMN2 (0.83) | SMN1; SMN2KDM4ELMNACYP1A2TSHR | |
| Iodamide SCHEMBL720586 | 0.89 | SMN1; SMN2 (0.79) | SMN1; SMN2KDM4ELMNACYP1A2TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10722562-B2 | Combinatorial analysis and repair | IMMUDEX APS (DK) | 2020-07-28 | — | — | US | disclosed |
| US-20120053212-A1 | METHODS OF TREATING HUMANS UNDERGOING INJECTION OF A CONTRAST AGENT | SHIVA BIOMEDICAL, LLC (US) | 2012-03-01 | — | — | US | disclosed |
| US-20110212090-A1 | Combinatorial Analysis and Repair | DAKO DENMARK A/S | 2011-09-01 | — | — | US | disclosed |
| US-20100266501-A1 | METHODS AND COMPOSITIONS FOR ORGAN PROTECTION | University Of Vermont and State Agricltural College (US) | 2010-10-21 | — | — | US | disclosed |
| WO-2010009735-A2 | COMBINATORIAL ANALYSIS AND REPAIR | DAKO DENMARK A/S (DK) | 2010-01-28 | — | — | WO | disclosed |
| US-20080293779-A1 | Methods of treating humans undergoing injection of a contrast agent | SHIVA BIOMEDICAL, LLC (US) | 2008-11-27 | — | — | US | disclosed |
| US-20060127315-A1 | Methods of treating humans undergoing injection of a contrast agent | SHIVA BIOMEDICAL, L.L.C. (US) | 2006-06-15 | — | — | US | disclosed |